반응식
[CH3:42][OH:43].[Cl:1][c:2]1[cH:3][c:4]([NH:12][C:13]([c:14]2[cH:15][cH:16][c:17]([C:20]([CH3:21])([CH3:22])[OH:23])[cH:18][cH:19]2)=[O:24])[n:5][c:6]2[n:7]1[n:8][c:9]([CH3:11])[cH:10]2.[Cl:25][c:26]1[c:27]([O:35][CH3:36])[cH:28][c:29]([B:32]([OH:33])[OH:34])[cH:30][cH:31]1.[Na+:41].[O-:37][C:38]([OH:39])=[O:40]>>[c:2]1(-[c:29]2[cH:28][c:27]([O:35][CH3:36])[c:26]([Cl:25])[cH:31][cH:30]2)[cH:3][c:4]([NH:12][C:13]([c:14]2[cH:15][cH:16][c:17]([C:20]([CH3:21])([CH3:22])[OH:23])[cH:18][cH:19]2)=[O:24])[n:5][c:6]2[n:7]1[n:8][c:9]([CH3:11])[cH:10]2참가 물질
6
반응물 5
생성물 1
출처 및 근거
- ORD 기록
- ord-a0cf5e9d52144310976f2ce664c3f775
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
연결된 노트
불러오는 중…